[2-acetyloxy-4-(4-methylsulfanyl-6-oxidanylidene-1H-1,3,5-triazin-2-yl)phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-(4-methylsulfanyl-6-oxidanylidene-1H-1,3,5-triazin-2-yl)phenyl] ethanoate Openeye Name: [2-acetoxy-4-(4-methylsulfanyl-6-oxo-1H-1,3,5-triazin-2-yl)phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[4-(methylthio)-6-oxo-1H-1,3,5-triazin-2-yl]phenyl] ester IUPAC Name: [2-acetyloxy-4-(4-methylsulfanyl-6-oxo-1H-1,3,5-triazin-2-yl)phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[6-keto-4-(methylthio)-1H-s-triazin-2-yl]phenyl] ester Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C2=NC(=NC(=O)N2)SC)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C2=NC(=NC(=O)N2)SC)OC(=O)C

InChI

InChI=1S/C14H13N3O5S/c1-7(18)21-10-5-4-9(6-11(10)22-8(2)19)12-15-13(20)17-14(16-12)23-3/h4-6H,1-3H3,(H,15,16,17,20)